(4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)
TL;DR: (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) (CAS 87298-97-3) is a chemical compound with molecular formula C28H44N2O10S2 and molecular weight 632.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-[bis(2-hydroxyethyl)amino]ethanol);2-[4-[4-(carboxymethylsulfanyl)phenyl]phenyl]sulfanylacetic acid
Also Known As: (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2), Acetic acid, (4,4'-biphenylylenedithio)di-, compd. with 2,2',2''-nitrilotris(ethanol) (1:2), 2,2'-[[1,1'-Biphenyl]-4,4'-diylbis(sulfanediyl)]diacetic acid--2,2',2''-nitrilotri(ethan-1-ol) (1/2), 2-[bis(2-hydroxyethyl)amino]ethanol; 2-[4-[4-(carboxymethylsulfanyl)phenyl]phenyl]sulfanylacetic acid, RefChem:316214
| Molecular Formula | C28H44N2O10S2 |
|---|---|
| Molecular Weight | 632.24 g/mol |
| LogP | 0.2376 |
| Topological Polar Surface Area | 202.46 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 19 |
| Exact Mass | 632.2437 |
| Heavy Atoms | 42 |
| Complexity | 846.6822 |
Chemical Identifiers
| CAS Number | 87298-97-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)SCC(=O)O)SCC(=O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO |
Product Overview
(4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) (CAS 87298-97-3), with molecular formula C28H44N2O10S2 and molecular weight 632.24 g/mol. IUPAC: bis(2-[bis(2-hydroxyethyl)amino]ethanol);2-[4-[4-(carboxymethylsulfanyl)phenyl]phenyl]sulfanylacetic acid.
Chemical Property Profile of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)
Property Insights of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)
The XLogP value of 0.2376 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2). The TPSA of 202.46 Ų indicates high polarity, suggesting (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)?
The CAS number of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) is 87298-97-3.
What is the molecular formula of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)?
The molecular formula of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) is C28H44N2O10S2.
What is the molecular weight of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)?
The molecular weight of (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) is 632.24 g/mol.
Where can I buy (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)?
You can request a quote for (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2)?
Yes, KEHONG BIO provides custom synthesis services for (4,4'-Biphenylylenedithio)diacetic acid 2,2',2''-nitrilotriethanol salt (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.